D753-0250 Screening compound: 4-methyl-N-{trans-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-3-(1H-tetrazol-1-yl)benzamide

D753-0250 Screening compound: 4-methyl-N-{trans-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-3-(1H-tetrazol-1-yl)benzamide
D753-0250 Screening compound: 4-methyl-N-{trans-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-3-(1H-tetrazol-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D753-0250
4-methyl-N-{trans-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-3-(1H-tetrazol-1-yl)benzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D753-0250

Molecular Formula

C24H26N6O2 (C24 H26 N6 O2)

Compound Name

4-methyl-N-{trans-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-3-(1H-tetrazol-1-yl)benzamide

IUPAC name

4-methyl-N-[(1r4r)-4-[(1-oxo-23-dihydro-1H-isoindol-2-yl)methyl]cyclohexyl]-3-(1H-1234-tetrazol-1-yl)benzamide

SMILES

Cc(ccc(C(N[C@H]1CC[C@H](CN(Cc2c3cccc2)C3=O)CC1)=O)c1)c1-n1nnnc1

InChI

InChI=1S/C24H26N6O2/c1-16-6-9-18(12-22(16)30-15-25-27-28-30)23(31)26-20-10-7-17(8-11-20)13-29-14-19-4-2-3-5-21(19)24(29)32/h2-6,9,12,15,17,20H,7-8,10-11,13-14H2,1H3,(H,26,31)

InChI Key

QBCHHMWZQWEVEH-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.217

Distribution Coefficient, logD

3.217

Water Solubility, LogSw

-3.74

Polar Surface Area

80.488

Acid Dissociation Constant (pKa)

14.12

Base Dissociation Constant (pKb)

-1.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with D753-0250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D753-0250?
Check Price and Availability of D753-0250, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D753-0250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D753-0250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D753-0250
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D753-0250 available by request